Cyclohexylamine

Cyclohexylamine

SCHEMBL10933743

C=Cn1c2ccc(C)cc2c2cc(C)ccc21.NC1CCCCC1

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 5/20 0.34
USP2 O75604 1/20 0.34
CNR1 P21554 1/20 0.33
KDM4E B2RXH2 4/20 0.33
TP53 P04637 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
HTR1A P08908 1/20 0.33
ADRA2A P08913 1/20 0.33
CHRM1 P11229 1/20 0.33
MAOA P21397 1/20 0.33
DRD1 P21728 1/20 0.33
SLC6A2 P23975 1/20 0.33
TEAD1 P28347 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
KCNH2 Q12809 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4987809 0.82 MAPT (0.40) USP2KDM4ETP53MEN1KMT2A
SCHEMBL4985558 0.74 MAPT (0.41) HSD17B10KDM4EMEN1KMT2AADRA2A
SCHEMBL11879601 0.73 DNM1 (0.37) KMT2AALDH1A1SMN1; SMN2HTTNPSR1
SCHEMBL15356181 0.65 KIF11 (0.38) HSD17B10KDM4ETP53MEN1KMT2A
SCHEMBL11655690 0.64 MAPT (0.42) HSD17B10KDM4EMEN1KMT2ACYP3A4
SCHEMBL24305760 0.64 HTR6 (0.34) HSD17B10ADRA2AHTR6
Cyclohexylamine SCHEMBL7797971 0.63 CYP2A6 (0.59) KDM4EKMT2ACYP1A2CYP3A4ALDH1A1
Toluene SCHEMBL4063031 0.62 TSHR (0.50) KDM4EMEN1KMT2ACYP1A2CYP3A4
SCHEMBL29846207 0.61 ALDH1A1 (0.40) HSD17B10USP2KDM4ETP53MEN1
SCHEMBL17461038 0.61 ALDH1A1 (0.40) HSD17B10USP2KDM4ETP53MEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4631247-A Acetylene compounds as shelf life improvers for photoresist compositions containing organic iodides HERCULES INCORPORATED (US) 1986-12-23 US disclosed